Cas no 59753-16-1 (2-Thiophenecarboxylicacid, lithium salt (1:1))

2-Thiophenecarboxylicacid, lithium salt (1:1) structure
59753-16-1 structure
Product Name:2-Thiophenecarboxylicacid, lithium salt (1:1)
CAS No:59753-16-1
MF:C5H3LiO2S
MW:134.08212018013
CID:377255
PubChem ID:19205771
Update Time:2025-04-19

2-Thiophenecarboxylicacid, lithium salt (1:1) Chemical and Physical Properties

Names and Identifiers

    • 2-Thiophenecarboxylicacid, lithium salt (1:1)
    • lithium 2-thenoate
    • lithium,thiophene-2-carboxylic acid
    • EINECS 261-914-5
    • Lithium 2-thiophenecarboxylate
    • 59753-16-1
    • THEONATE LITHIUM [WHO-DD]
    • 2-THIOPHENECARBOXYLIC ACID, LITHIUM SALT (1:1)
    • Q27276945
    • THEONATE LITHIUM
    • AKOS022191019
    • THIOPHEOL
    • 2-THIOPHENECARBOXYLIC ACID, LITHIUM SALT
    • E6U3083F18
    • lithium thiophene carboxylate
    • NS00088357
    • SLIT
    • AKOS003025207
    • UNII-E6U3083F18
    • Inchi: 1S/C5H4O2S.Li/c6-5(7)4-2-1-3-8-4;/h1-3H,(H,6,7);/q;+1/p-1
    • InChI Key: SQEHCNOBYLQFTG-UHFFFAOYSA-M
    • SMILES: S1C=CC=C1C(=O)[O-].[Li+]

Computed Properties

  • Exact Mass: 135.00900
  • Monoisotopic Mass: 134.00137894g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 103
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 1
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 68.4?2

Experimental Properties

  • PSA: 65.54000
  • LogP: 1.44630
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